4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine

C10H18N4 — CID 10679361

IUPAC4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine
SMILESCCNc1cncc(NCC)c1CN
InChIInChI=1S/C10H18N4/c1-3-13-9-6-12-7-10(14-4-2)8(9)5-11/h6-7,13-14H,3-5,11H2,1-2H3
InChIKeySKGYFTATZNKEGD-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.40
Rot. Bonds5

About 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine

4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine (PubChem CID 10679361) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine.

Molecular Properties

Compound Name4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine
PubChem CID10679361
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine
SMILESCCNc1cncc(NCC)c1CN
InChIInChI=1S/C10H18N4/c1-3-13-9-6-12-7-10(14-4-2)8(9)5-11/h6-7,13-14H,3-5,11H2,1-2H3
InChIKeySKGYFTATZNKEGD-UHFFFAOYSA-N
XLogP1.40
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine?
The IUPAC name of 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine (CID 10679361) is 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine.
What is the SMILES notation for 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine?
The canonical SMILES for 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine is CCNc1cncc(NCC)c1CN.
What is the InChIKey of 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine?
The InChIKey is SKGYFTATZNKEGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-3-13-9-6-12-7-10(14-4-2)8(9)5-11/h6-7,13-14H,3-5,11H2,1-2H3.
What are the key properties of 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine?
4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine has a molecular weight of 194.28 g/mol, XLogP of 1.40, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-3-N,5-N-diethylpyridine-3,5-diamine is sourced from PubChem (CID 10679361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).